N-[4-(1,1,1,3,3,3-Hexafluoro-2-Hydroxy-2-Propanyl)Phenyl]-N-Methylbenzenesulfonamide

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Properties Simple | Detailed

Formula C16H13F6NO3S
IUPAC Name n-methyl-n-[4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenyl]benzenesulfonamide
Molecular Mass 413.335 g·mol−1
Heat of Formation -1630.1 ± 16.7 kJ·mol−1
Dipole Moment 8.19 ± 1.08 D
Volume 407.23 Å 3
Surface Area 345.46 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
Synonyms
  • n-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-n-methylbenzenesulfonamide
InChIKey CNVKZYLQZYULJV-UHFFFAOYSA-N
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